Chem
J-GLOBAL ID：200907050456045240
Nikkaji number：J2.262.720A
(1R,4S)-6-(4-Methoxyphenyl)-7,7-dimethyl-2-azabicyclo[2.2.2]octane-5-one
(1R,4S)-6-(4-メトキシフェニル)-7,7-ジメチル-2-アザビシクロ[2.2.2]オクタン-5-オン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C16H21NO2
Molecular formula furigana： C16-H21-N-O2
Molecular weight： 259.349
InChI：
InChI=1S/C16H21NO2/c1-16(2)8-11-9-17-15(16)13(14(11)18)10-4-6-12(19-3)7-5-10/h4-7,11,13,15,17H,8-9H2,1-3H3/t11-,13?,15+/m0/s1
InChI key：
VYCXIBUHNCBMSU-LKVSRFHLSA-N
SMILES：
COc1ccc(cc1)C1[C@H]2NC[C@H](CC2(C)C)C1=O
Systematic name (2)：
- (1R,4S)-6-(4-メトキシフェニル)-7,7-ジメチル-2-アザビシクロ[2.2.2]オクタン-5-オン
- (1R,4S)-6-(4-methoxyphenyl)-7,7-dimethyl-2-azabicyclo[2.2.2]octan-5-one
- (1R,4S)-6-(4-Methoxyphenyl)-7,7-dimethyl-2-azabicyclo[2.2.2]octane-5-one
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